[(3S)-3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]-(6-methylquinolin-4-yl)methanone

Systemtic Name: [(3S)-3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]-(6-methylquinolin-4-yl)methanone Openeye Name: [(3S)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-piperidyl]-(6-methyl-4-quinolyl)methanone CAS Name: [(3S)-3-[4-(2-methoxyphenyl)-1-piperazinyl]-1-piperidinyl]-(6-methyl-4-quinolinyl)methanone IUPAC Name: [(3S)-3-[4-(2-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]-(6-methylquinolin-4-yl)methanone Traditional Name: [(3S)-3-[4-(2-methoxyphenyl)piperazino]piperidino]-(6-methyl-4-quinolyl)methanone Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CN=C2C=C1)C(=O)N3CCCC(C3)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC1=CC2=C(C=CN=C2C=C1)C(=O)N3CCC[C@@H](C3)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C27H32N4O2/c1-20-9-10-24-23(18-20)22(11-12-28-24)27(32)31-13-5-6-21(19-31)29-14-16-30(17-15-29)25-7-3-4-8-26(25)33-2/h3-4,7-12,18,21H,5-6,13-17,19H2,1-2H3/t21-/m0/s1